SCHEMBL10471728

SCHEMBL10471728

C=CC(=O)OC(COC(=O)CCc1cc(-n2nc3ccccc3n2)c(O)c(C(C)(C)C)c1)COc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ GAA P10253 5/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ MAOB P27338 3/20 0.34
▸ MAOA P21397 2/20 0.34
▸ ACHE P22303 1/20 0.33
▸ THRB P10828 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ AGTR1 P30556 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ POLB P06746 1/20 0.32
▸ ALOX5 P09917 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9228497 0.91 GAA (0.35) ALDH1A1MAPTKDM4ENPC1HPGD
SCHEMBL9228170 0.88 MAOB (0.34) ALDH1A1KDM4EGAAKMT2AMEN1
SCHEMBL9230351 0.88 ALDH1A1 (0.38) ALDH1A1MAPTKDM4ENPC1HPGD
SCHEMBL9227024 0.87 GAA (0.34) ALDH1A1MAPTKDM4ENPC1HPGD
SCHEMBL10470440 0.87 MAOB (0.34) ALDH1A1MAPTKDM4ENPC1HPGD
SCHEMBL10472398 0.85 KDM4E (0.41) ALDH1A1MAPTKDM4ENPC1HPGD
SCHEMBL9230983 0.85 GAA (0.35) ALDH1A1MAPTKDM4ENPC1HPGD
SCHEMBL9231365 0.82 MAOB (0.35) ALDH1A1MAPTKDM4ENPC1HPGD
SCHEMBL10470534 0.82 GAA (0.38) ALDH1A1MAPTKDM4ENPC1HPGD
SCHEMBL10395151 0.81 GAA (0.35) ALDH1A1MAPTKDM4ENPC1HPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4892915-A Copolymers of 2-(2-hydroxy-5-acryloyloxyalkyl)phenyl-2H-benzotriazoles CIBA-GEIGY CORPORATION (US) 1990-01-09 — — US disclosed
US-4785063-A LIGHT STABILIZERS CIBA-GEIGY CORPORATION (US) 1988-11-15 — — US disclosed
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